%chk=000010164.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010164

0 1
 O  -0.1859000       1.315600      -1.491900    
 O   -5.019400       1.916700      0.8070000    
 O   -6.159600      5.4900002E-02 -0.2112000    
 O    4.351000      -1.503100      0.2882000    
 O    5.823400      0.8206000      0.1579000    
 N   0.1201000      -1.376300     -0.3048000    
 C  -0.5395000     -0.2323000      0.3732000    
 C   0.1614000       1.060000     -0.1289000    
 C   -2.056000     -0.1880000      0.1855000    
 C  -0.6247000      -2.623100     -0.1156000    
 C    1.505500      -1.527600      0.1742000    
 C   -1.975000      -2.514100     -0.8187000    
 C   -2.742000      -1.297800     -0.3734000    
 C    1.668200      0.9892000     -3.6400001E-02
 C    2.311300     -0.2547000      7.4400000E-02
 C   -2.796400      0.9246000      0.6259000    
 C   -4.135200      -1.264100     -0.5500000    
 C    3.709900     -0.3059000      0.1494000    
 C    2.435200       2.161000     -0.1015000    
 C   -4.165400      0.9190000      0.4487000    
 C   -4.816100     -0.1429000     -0.1285000    
 C    4.463400      0.8660000      9.0000004E-02
 C    3.826800       2.098200     -3.7599999E-02
 C   -6.281500       1.364000      0.3813000    
 C    4.590500      -1.956500       1.617700    
 C    6.529900      0.6964000      -1.074700    
 H  -0.3763000     -0.3302000       1.457600    
 H  -0.1750000       1.919100      0.4625000    
 H  -0.7607000      -2.843800      0.9517000    
 H  -7.9700001E-02  -3.466600     -0.5569000    
 H    1.992100      -2.298800     -0.4356000    
 H    1.511400      -1.861000       1.219800    
 H   -2.554900      -3.420100     -0.6055000    
 H   -1.831600      -2.457100      -1.905200    
 H   -2.316600       1.774100       1.099600    
 H   -4.663900      -2.099600     -0.9969000    
 H    1.950700       3.128900     -0.2021000    
 H   4.6000001E-03  0.5098000      -2.002600    
 H    4.407800       3.015200     -8.5900001E-02
 H   -6.731700       2.041500     -0.3534000    
 H   -6.945700       1.295500       1.250400    
 H    4.995700      -2.970700       1.565200    
 H    3.667500      -1.980200       2.204300    
 H    5.326400      -1.313200       2.110300    
 H    6.330700       1.558500      -1.719200    
 H    6.250500     -0.2292000      -1.587900    
 H    7.600300      0.6644000     -0.8542000    


%chk=000010164-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000010164

0 1
O -0.232099 0.991239 -1.851619
O -5.091374 1.805210 1.233173
O -6.279202 0.065455 0.088828
O 4.282633 -1.491372 0.412749
O 5.813008 0.992406 0.326784
N 0.089237 -1.369795 -0.396231
C -0.561562 -0.209596 0.277259
C 0.084726 1.031855 -0.414695
C -2.084307 -0.220381 0.172403
C -0.683077 -2.630762 -0.356609
C 1.487611 -1.532753 0.063297
C -2.020936 -2.432032 -1.084967
C -2.788470 -1.261973 -0.486638
C 1.590800 1.018736 -0.180210
C 2.255744 -0.218930 0.026244
C -2.791632 0.856515 0.785202
C -4.212316 -1.235424 -0.571358
C 3.658550 -0.232384 0.222094
C 2.334745 2.222193 -0.182838
C -4.178667 0.867777 0.677529
C -4.878308 -0.157049 0.005458
C 4.405887 0.976203 0.161631
C 3.734461 2.204330 -0.020012
C -6.407815 1.436021 0.650907
C 5.003047 -1.644766 1.699078
C 6.561488 0.317360 -0.759577
H -0.290741 -0.176195 1.363756
H -0.360712 1.973299 -0.052079
H -0.868400 -2.971299 0.692237
H -0.083228 -3.411972 -0.859529
H 1.994557 -2.275517 -0.577991
H 1.524008 -1.943786 1.105829
H -2.625050 -3.356662 -1.020570
H -1.815943 -2.249932 -2.158716
H -2.265845 1.651588 1.322045
H -4.760598 -2.040428 -1.069206
H 1.813386 3.173357 -0.338033
H -0.067128 0.035227 -2.100614
H 4.329033 3.122943 -0.040219
H -6.649409 2.139496 -0.169165
H -7.163790 1.426264 1.450221
H 5.438574 -2.655229 1.670616
H 4.295099 -1.562246 2.545604
H 5.794114 -0.881077 1.800174
H 6.395704 0.843786 -1.718566
H 6.253871 -0.739946 -0.855147
H 7.621823 0.386543 -0.472328


